Potassium in PDB 2hri: A Parallel Stranded Human Telomeric Quadruplex in Complex with the Porphyrin TMPYP4
Protein crystallography data
The structure of A Parallel Stranded Human Telomeric Quadruplex in Complex with the Porphyrin TMPYP4, PDB code: 2hri
was solved by
G.N.Parkinson,
R.Ghosh,
S.Neidle,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
28.35 /
2.09
|
Space group
|
C 2 2 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
37.290,
61.990,
61.400,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
19.8 /
24.8
|
Potassium Binding Sites:
The binding sites of Potassium atom in the A Parallel Stranded Human Telomeric Quadruplex in Complex with the Porphyrin TMPYP4
(pdb code 2hri). This binding sites where shown within
5.0 Angstroms radius around Potassium atom.
In total 3 binding sites of Potassium where determined in the
A Parallel Stranded Human Telomeric Quadruplex in Complex with the Porphyrin TMPYP4, PDB code: 2hri:
Jump to Potassium binding site number:
1;
2;
3;
Potassium binding site 1 out
of 3 in 2hri
Go back to
Potassium Binding Sites List in 2hri
Potassium binding site 1 out
of 3 in the A Parallel Stranded Human Telomeric Quadruplex in Complex with the Porphyrin TMPYP4
 Mono view
 Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 1 of A Parallel Stranded Human Telomeric Quadruplex in Complex with the Porphyrin TMPYP4 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:K23
b:20.4
occ:1.00
|
O6
|
B:DG15
|
2.8
|
21.4
|
1.0
|
O6
|
A:DG10
|
2.8
|
17.6
|
1.0
|
O6
|
B:DG16
|
2.8
|
17.5
|
1.0
|
O6
|
B:DG21
|
2.8
|
21.5
|
1.0
|
O6
|
B:DG22
|
2.8
|
18.7
|
1.0
|
O6
|
A:DG4
|
2.9
|
17.6
|
1.0
|
O6
|
A:DG5
|
2.9
|
16.9
|
1.0
|
O6
|
A:DG11
|
2.9
|
18.8
|
1.0
|
K
|
A:K24
|
3.4
|
21.0
|
0.5
|
K
|
A:K25
|
3.6
|
21.2
|
1.0
|
C6
|
B:DG15
|
3.7
|
17.9
|
1.0
|
C6
|
A:DG10
|
3.7
|
13.8
|
1.0
|
C6
|
B:DG16
|
3.7
|
17.7
|
1.0
|
C6
|
B:DG21
|
3.7
|
20.6
|
1.0
|
C6
|
A:DG4
|
3.7
|
14.5
|
1.0
|
C6
|
A:DG5
|
3.7
|
15.2
|
1.0
|
C6
|
B:DG22
|
3.7
|
18.2
|
1.0
|
C6
|
A:DG11
|
3.9
|
15.8
|
1.0
|
N1
|
B:DG16
|
3.9
|
17.4
|
1.0
|
N1
|
A:DG10
|
3.9
|
12.7
|
1.0
|
N1
|
B:DG21
|
4.0
|
17.9
|
1.0
|
N1
|
A:DG5
|
4.0
|
14.5
|
1.0
|
N1
|
B:DG15
|
4.0
|
15.8
|
1.0
|
N1
|
B:DG22
|
4.0
|
16.2
|
1.0
|
N1
|
A:DG4
|
4.0
|
12.1
|
1.0
|
N1
|
A:DG11
|
4.1
|
15.4
|
1.0
|
C5
|
B:DG15
|
4.9
|
17.7
|
1.0
|
C5
|
A:DG10
|
4.9
|
14.9
|
1.0
|
C5
|
B:DG16
|
4.9
|
15.3
|
1.0
|
C5
|
A:DG4
|
4.9
|
14.2
|
1.0
|
C5
|
A:DG5
|
4.9
|
15.8
|
1.0
|
C5
|
B:DG21
|
4.9
|
19.8
|
1.0
|
C5
|
B:DG22
|
5.0
|
17.3
|
1.0
|
|
Potassium binding site 2 out
of 3 in 2hri
Go back to
Potassium Binding Sites List in 2hri
Potassium binding site 2 out
of 3 in the A Parallel Stranded Human Telomeric Quadruplex in Complex with the Porphyrin TMPYP4
 Mono view
 Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 2 of A Parallel Stranded Human Telomeric Quadruplex in Complex with the Porphyrin TMPYP4 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:K24
b:21.0
occ:0.50
|
O6
|
A:DG5
|
2.8
|
16.9
|
1.0
|
O6
|
B:DG16
|
2.8
|
17.5
|
1.0
|
O6
|
B:DG22
|
2.9
|
18.7
|
1.0
|
O6
|
A:DG11
|
2.9
|
18.8
|
1.0
|
K
|
A:K23
|
3.4
|
20.4
|
1.0
|
C6
|
B:DG16
|
3.7
|
17.7
|
1.0
|
C6
|
B:DG22
|
3.7
|
18.2
|
1.0
|
C6
|
A:DG5
|
3.7
|
15.2
|
1.0
|
C6
|
A:DG11
|
3.8
|
15.8
|
1.0
|
N1
|
B:DG16
|
3.9
|
17.4
|
1.0
|
N1
|
B:DG22
|
4.0
|
16.2
|
1.0
|
N1
|
A:DG5
|
4.0
|
14.5
|
1.0
|
N1
|
A:DG11
|
4.1
|
15.4
|
1.0
|
C5
|
B:DG16
|
4.8
|
15.3
|
1.0
|
C5
|
B:DG22
|
4.9
|
17.3
|
1.0
|
C5
|
A:DG5
|
4.9
|
15.8
|
1.0
|
|
Potassium binding site 3 out
of 3 in 2hri
Go back to
Potassium Binding Sites List in 2hri
Potassium binding site 3 out
of 3 in the A Parallel Stranded Human Telomeric Quadruplex in Complex with the Porphyrin TMPYP4
 Mono view
 Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 3 of A Parallel Stranded Human Telomeric Quadruplex in Complex with the Porphyrin TMPYP4 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:K25
b:21.2
occ:1.00
|
O6
|
A:DG3
|
2.6
|
22.5
|
1.0
|
O6
|
B:DG20
|
2.7
|
22.3
|
1.0
|
O6
|
B:DG14
|
2.7
|
19.9
|
1.0
|
O6
|
A:DG9
|
2.7
|
19.3
|
1.0
|
O6
|
A:DG10
|
2.9
|
17.6
|
1.0
|
O6
|
B:DG15
|
3.0
|
21.4
|
1.0
|
O6
|
A:DG4
|
3.0
|
17.6
|
1.0
|
O6
|
B:DG21
|
3.1
|
21.5
|
1.0
|
C6
|
A:DG3
|
3.5
|
21.0
|
1.0
|
C6
|
B:DG20
|
3.5
|
19.2
|
1.0
|
K
|
A:K23
|
3.6
|
20.4
|
1.0
|
C6
|
A:DG9
|
3.6
|
15.0
|
1.0
|
C6
|
B:DG14
|
3.7
|
19.4
|
1.0
|
N6
|
B:DA13
|
3.7
|
19.0
|
1.0
|
N1
|
B:DG20
|
3.7
|
19.9
|
1.0
|
C6
|
A:DG10
|
3.7
|
13.8
|
1.0
|
C6
|
A:DG4
|
3.8
|
14.5
|
1.0
|
C6
|
B:DG15
|
3.8
|
17.9
|
1.0
|
N1
|
A:DG3
|
3.8
|
20.3
|
1.0
|
N1
|
A:DG9
|
3.9
|
18.5
|
1.0
|
N1
|
B:DG14
|
3.9
|
19.0
|
1.0
|
N1
|
A:DG4
|
4.0
|
12.1
|
1.0
|
C6
|
B:DG21
|
4.0
|
20.6
|
1.0
|
N1
|
A:DG10
|
4.0
|
12.7
|
1.0
|
N1
|
B:DG15
|
4.1
|
15.8
|
1.0
|
N1
|
B:DG21
|
4.2
|
17.9
|
1.0
|
C6
|
B:DA13
|
4.5
|
20.6
|
1.0
|
C5
|
A:DG3
|
4.7
|
21.0
|
1.0
|
C5
|
B:DG20
|
4.8
|
19.6
|
1.0
|
C5
|
A:DG9
|
4.8
|
14.8
|
1.0
|
C5
|
A:DG10
|
4.9
|
14.9
|
1.0
|
C5
|
B:DG14
|
4.9
|
18.6
|
1.0
|
C5
|
B:DG15
|
5.0
|
17.7
|
1.0
|
|
Reference:
G.N.Parkinson,
R.Ghosh,
S.Neidle.
Structural Basis For Binding of Porphyrin to Human Telomeres. Biochemistry V. 46 2390 2007.
ISSN: ISSN 0006-2960
PubMed: 17274602
DOI: 10.1021/BI062244N
Page generated: Mon Aug 12 06:34:55 2024
|